Information card for entry 2105686

Structure parameters

• Formula: C9 H18 N3 S6 Sb
• Calculated formula: C9 H18 N3 S6 Sb
• SMILES: [Sb]123([S]=C(S1)N(C)C)(SC(=[S]2)N(C)C)SC(=[S]3)N(C)C
• Title of publication: Supramolecular association <i>via</i> Sb···S and C—H···S interactions in dimeric <i>tris</i>(<i>N</i>,<i>N</i>-dimethyldithiocarbamato-<i>S</i>,<i>S</i>')antimony(III): an approach to overcome the concept of steric bulk on such interactions
• Authors of publication: Chauhan, H. P. S.; Carpenter, Jaswant
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 6
• Pages of publication: 613 - 620
• a: 10.8746 ± 0.0008 Å
• b: 11.2843 ± 0.0007 Å
• c: 15.0197 ± 0.0007 Å
• α: 99.886 ± 0.005°
• β: 96.852 ± 0.005°
• γ: 94.714 ± 0.005°
• Cell volume: 1792.8 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1644
• Residual factor for significantly intense reflections: 0.1432
• Weighted residual factors for significantly intense reflections: 0.3653
• Weighted residual factors for all reflections included in the refinement: 0.4007
• Goodness-of-fit parameter for all reflections included in the refinement: 1.422
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No